O4-cyclobutyl O1-[(4-methoxyphenyl)methyl] (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioate

Systemtic Name: O4-cyclobutyl O1-[(4-methoxyphenyl)methyl] (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioate Openeye Name: O4-cyclobutyl O1-[(4-methoxyphenyl)methyl] (2S)-2-(tert-butoxycarbonylamino)butanedioate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanedioic acid O4-cyclobutyl ester O1-[(4-methoxyphenyl)methyl] ester IUPAC Name: 4-O-cyclobutyl 1-O-[(4-methoxyphenyl)methyl] (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)succinic acid O4-cyclobutyl ester O1-p-anisyl ester Formula: C21H29NO7 MolecularWeight: 407.45746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC(=O)OC1CCC1)C(=O)OCC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC(=O)OC1CCC1)C(=O)OCC2=CC=C(C=C2)OC

InChI

InChI=1S/C21H29NO7/c1-21(2,3)29-20(25)22-17(12-18(23)28-16-6-5-7-16)19(24)27-13-14-8-10-15(26-4)11-9-14/h8-11,16-17H,5-7,12-13H2,1-4H3,(H,22,25)/t17-/m0/s1